Geometry & MOs

Info

ID:	225903
PubChem CID:	87246406
Reduced:	NPBr2O7H22C24 (1)
Stoich.:	ABC2D7E22F24 (1)
Weight, g/mol:	194.220851
ΔH_f, kcal/mol:	-232.0
Dipole, Da:	9.34
IP(EA), eV:	-9.03(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C(=C1)Br)OC2=CC(=C(C=C2)O)C(=O)NCCC3=CC=C(C=C3)C(=O)O)Br)(O)P=O

DOS

IR

Vibrations